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CHEBI:191537 - beta-Kessyl alcohol

Default Structure
ChEBI IDCHEBI:191537
ChEBI Namebeta-Kessyl alcohol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O2
Net Charge0
Average Mass238.371
Monoisotopic Mass238.19328
SMILES[H][C@]12[C@H](O)C[C@@H](C)[C@@]1([H])C[C@]1(C(C)C)CC[C@@]2(C)O1
InChIInChI=1S/C15H26O2/c1-9(2)15-6-5-14(4,17-15)13-11(8-15)10(3)7-12(13)16/h9-13,16H,5-8H2,1-4H3/t10-,11-,12-,13-,14-,15+/m1/s1
InChIKeyVWQSEENZNJRXDR-OJVARPOJSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
beta-Kessyl alcohol (CHEBI:191537) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,2R,3R,5R,6R,8S)-1,5-dimethyl-8-propan-2-yl-11-oxatricyclo[6.2.1.02,6]undecan-3-ol
Manual XrefsDatabases
103883060ChemSpider